| SpectraBase Compound ID | BnRIh0Kl9xf |
|---|---|
| InChI | InChI=1S/C5H6ClNO/c6-4-2-1-3-7-5(4)8/h2H,1,3H2,(H,7,8) |
| InChIKey | MDCPVYOIYISUFL-UHFFFAOYSA-N |
| Mol Weight | 131.56 g/mol |
| Molecular Formula | C5H6ClNO |
| Exact Mass | 131.013792 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DBWmY8dV3pH |
|---|---|
| Name | 3-Chloro-5,6-dihydro-1H-pyridin-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 131.013791516 u |
| Formula | C5H6ClNO |
| InChI | InChI=1S/C5H6ClNO/c6-4-2-1-3-7-5(4)8/h2H,1,3H2,(H,7,8) |
| InChIKey | MDCPVYOIYISUFL-UHFFFAOYSA-N |
| Molecular Weight | 131.562 g/mol |
| SMILES | C1=C(C(NCC1)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91192 |